SCHEMBL17855983

SCHEMBL17855983

C=Cc1ccc(C23CC4CC(C2)CC(c2ccc(N(c5ccc(OC)cc5)c5ccc(OC)cc5)cc2)(C4)C3)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.44
LMNA P02545 4/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
ESR1 P03372 1/20 0.42
PGR P06401 8/20 0.42
KDM4E B2RXH2 2/20 0.36
NPC1 O15118 1/20 0.36
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
MDM2 Q00987 1/20 0.36
GRIN2D O15399 1/20 0.36
GRIN3B O60391 1/20 0.36
GRIN1 Q05586 1/20 0.36
GRIN2A Q12879 1/20 0.36
GRIN2B Q13224 1/20 0.36
GRIN2C Q14957 1/20 0.36
GRIN3A Q8TCU5 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
ALDH1A1 P00352 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL17852970 0.92 HSD11B1 (0.43) HSD11B1LMNASMN1; SMN2ESR1PGR
SCHEMBL17854955 0.90 HSD11B1 (0.40) HSD11B1LMNASMN1; SMN2ESR1PGR
SCHEMBL17852971 0.86 KMT2A (0.48) HSD11B1LMNASMN1; SMN2PGRMEN1
SCHEMBL17852865 0.86 HSD11B1 (0.39) HSD11B1LMNASMN1; SMN2ESR1PGR
SCHEMBL17852969 0.85 GRIN2D (0.49) HSD11B1LMNASMN1; SMN2ESR1PGR
SCHEMBL16352314 0.81 LMNA (0.56) HSD11B1LMNASMN1; SMN2ESR1PGR
SCHEMBL8766728 0.81 LMNA (0.56) HSD11B1LMNASMN1; SMN2ESR1PGR
SCHEMBL17852977 0.79 HSD11B1 (0.42) HSD11B1PGRGRIN2DGRIN3BGRIN1
SCHEMBL17852974 0.78 KMT2A (0.41) HSD11B1SMN1; SMN2PGRGRIN2DGRIN3B
SCHEMBL17370933 0.78 LMNA (0.38) HSD11B1LMNASMN1; SMN2ESR1PGR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160181535-A1 MATERIAL FOR ORGANIC LIGHT-EMITTING DEVICE AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-06-23 US disclosed